[3-nitro-4-(3-oxidanylpropyl)phenyl]-phenyl-methanone

Systemtic Name: [3-nitro-4-(3-oxidanylpropyl)phenyl]-phenyl-methanone Openeye Name: [4-(3-hydroxypropyl)-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-(3-hydroxypropyl)-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-(3-hydroxypropyl)-3-nitrophenyl]-phenylmethanone Traditional Name: [4-(3-hydroxypropyl)-3-nitro-phenyl]-phenyl-methanone Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)CCCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)CCCO)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO4/c18-10-4-7-12-8-9-14(11-15(12)17(20)21)16(19)13-5-2-1-3-6-13/h1-3,5-6,8-9,11,18H,4,7,10H2